COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK539216
Chemical Name: 2-{4-[(8S)-6-amino-5,7,7-tricyano-2-methyl-1,2,3,7,8,8a-hexahydroisoquinolin-8-yl]-2-methoxyphenoxy}acetamide
Smiles: N#CC1=C(N)C([C@@H](C2C1=CCN(C2)C)c1ccc(c(c1)OC)OCC(=O)N)(C#N)C#N

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Molecular Weight: 418.46
Empirical Formula: C22H22N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.715
Rotatable bonds: 4
H-donors: 4
H-acceptors: 3
PSA: 162
Number of rings: 3

     

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